Butyl vinyl ether
An ether, C6H12O, 100.161 g/mol. Boiling point 94 °C, melting point -92 °C, as published.
Identifiers
- Molecular formula
- C₆H₁₂O
- Molecular weight
- 100.161 g/mol
- Exact mass
- 100.088815 g/mol
- IUPAC name
- 1-ethenoxybutane
- C=COCCCC
- InChI=1S/C6H12O/c1-3-5-6-7-4-2/h4H,2-3,5-6H2,1H3
- UZKWTJUDCOPSNM-UHFFFAOYSA-N
Measured properties
- Boiling Point
- 94 °C
- Melting Point
- -92 °C
- Density
- 0.7888 at 20 °C/20 °C
- Bulk density: 7.45 lb/gal at 20 °C
- Solubility
- Sol in alc and ether
- Sol in acetone, benzene
- Vapor Pressure
- 49.1 [mmHg]
- 49 mm Hg at 25 °C /from experimentally derived coefficients/
- Flash Point
- 15 °F (NFPA, 2010)
- -9 °C (Open cup)
Calculated properties
- Molecular weight
- 100.16 g/mol
- Exact mass
- 100.088815002 Da
- XLogP3
- 2.1
- Polar surface area
- 9.2 Ų
- Complexity
- 41
- H-bond donors
- 0
- H-bond acceptors
- 1
- logP
- 1.9466
- Topological polar surface area
- 9.23 Ų
- H-bond donors
- 0
- H-bond acceptors
- 1
- Rotatable bonds
- 4
- Molar refractivity
- 31.057 cm³/mol
- Fraction sp³ carbons
- 0.6667
- QED drug-likeness
- 0.3873
What it is made of
Elements
Structure
- Heavy atoms, hydrogen excluded
- 7
- Total atoms, hydrogen included
- 19
- Rings
- 0
- Aromatic rings
- 0
- Stereocentres
- 0
- Formal charge
- 0
Functional groups
Ether
Alkene
The molecule in three dimensions
The drawing above is a diagram of what is bonded to what. A molecule is not flat, and the model here is one low-energy shape generated from the connectivity — useful for seeing which groups can reach each other, and not a measured structure. A real sample is a population of conformations, interconverting.
Reactions it appears in
Other names for it
The systematic name on this record is 1-ethenoxybutane.
The sources also call it Vinyl butyl ether, Butoxyethene, Butane, 1-(ethenyloxy)-, Butoxyethylene, Ether, butyl vinyl, Vinyl n-butyl ether, Agrisynth BVE, Butil vinil eter, Ether butylvinylique, 1-BUTOXYETHENE, Vinipol.
Structurally related
Molecules sharing this formula, or whose fingerprint is at least 40% similar to this one. Similarity is Tanimoto on Morgan fingerprints over this library only — it is a measure of structural overlap, not of how alike they behave.
Seen alongside it in reaction records
Molecules that appear in the same recorded reactions as Butyl vinyl ether. This says nothing about structure: most of them are the bases, solvents, ligands and catalysts the chemistry needed, and they are here because somebody put them in the same flask.
1,3,5-Trimethoxybenzene
formed as a product
C₉H₁₂O₃, 168.192 g/mol.
(Z)-(2-Butoxy-vinyl)-benzene
formed as a product
C₁₂H₁₆O, 176.259 g/mol.
(1-Butoxyethenyl)benzene
formed as a product
C₁₂H₁₆O, 176.259 g/mol.
1,3-Bis(diphenylphosphino)propane
C₂₇H₂₆P₂, 412.453 g/mol.
1,1'-Ferrocenediyl-bis(diphenylphosphine)
C₃₄H₂₈FeP₂, 554.391 g/mol.
1,3-Bis(2,4,6-trimethylphenyl)imidazolium chloride
C₂₁H₂₅ClN₂, 340.898 g/mol.
Where these values came from
chemistry engine
What this page does not claim
Identifiers are copied from the source record, measured values are reported as published, and calculated values are marked as calculated. Nothing here is a hazard, purity or handling assessment — how the library is checked.
Where to next
More molecules under B
The rest of this shelf, a hundred names at a time.
Molar mass calculator
Work with C6H12O in a calculation, with every element's contribution shown.
Molarity calculator
Grams of Butyl vinyl ether for a volume and a concentration, or the concentration a mass gives.
Open in ReactionLens
The full record in the workstation: every atom, every bond, and the reactions it appears in.